1-[[6-cyano-2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]-3-methyl-thiourea

Systemtic Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]-3-methyl-thiourea Openeye Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxo-1-pyridyl)chromen-3-yl]methyl]-3-methyl-thiourea CAS Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxo-1-pyridinyl)-1-benzopyran-3-yl]methyl]-3-methylthiourea IUPAC Name: 1-[[6-cyano-2,2-dimethyl-4-(2-oxopyridin-1-yl)chromen-3-yl]methyl]-3-methylthiourea Traditional Name: 1-[[6-cyano-4-(2-keto-1-pyridyl)-2,2-dimethyl-chromen-3-yl]methyl]-3-methyl-thiourea Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C2=C(O1)C=CC(=C2)C#N)N3C=CC=CC3=O)CNC(=S)NC)C

Isomeric SMILES

CC1(C(=C(C2=C(O1)C=CC(=C2)C#N)N3C=CC=CC3=O)CNC(=S)NC)C

InChI

InChI=1S/C20H20N4O2S/c1-20(2)15(12-23-19(27)22-3)18(24-9-5-4-6-17(24)25)14-10-13(11-21)7-8-16(14)26-20/h4-10H,12H2,1-3H3,(H2,22,23,27)